61849

2-[4-(2-Methylpropyl)phenyl]ethanol

pharmaceutical impurity standard

• Synonym(s): Ibuprofen impurity Q (PhEur), 4-(2-Methylpropyl)benzeneethanol, 4-Isobutylphenylethanol, NSC 69112
• Empirical Formula (Hill Notation): C₁₂H₁₈O
• CAS Number: 36039-35-7
• Molecular Weight: 178.27
• UNSPSC Code: 41116107
• NACRES: NA.24
• PubChem Substance ID: 329759692
• MDL number: MFCD08275595
• Beilstein/REAXYS Number: 1866730

Properties

• Quality Segment: 100
• API family: ibuprofen
• assay: ≥98.0% (HPLC)
• shelf life: limited shelf life, expiry date on the label
• impurities: ≤1% water
• application(s): pharmaceutical (small molecule)
• format: neat
• SMILES string: OCCC1=CC=C(CC(C)C)C=C1
• InChI: 1S/C12H18O/c1-10(2)9-12-5-3-11(4-6-12)7-8-13/h3-6,10,13H,7-9H2,1-2H3
• InChI key: CBKUDUSUCXBKIE-UHFFFAOYSA-N

Description

Safety Information

• Storage Class: 11 - Combustible Solids
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable